Compound Identification
SMILES
CC1=CC=C(C=C1)C(O)=C1C(N(C2=NC3=C(S2)C=C(F)C=C3)C(=O)C1=O)C1=CC=CO1
InChIKey
InChIKey=BAACHYFYEGCWJG-UHFFFAOYSA-N
Formula
C23H15FN2O4S
Mass
434.44
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Benzothiazoles
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzothiazoles
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Benzothiazoles
Alternative Parents
Toluenes Aryl fluorides Pyrrolidine-2-ones Pyrrolidine-3-ones Vinylogous acids Furans Heteroaromatic compounds Thiazoles Tertiary carboxylic acid amides Lactams Cyclic ketones Oxacyclic compounds Enols Azacyclic compounds Organic oxides Hydrocarbon derivatives Organofluorides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1,3-benzothiazole - Toluene - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Pyrrolidone - 2-pyrrolidone - 3-pyrrolidone - Benzenoid - Azole - Furan - Pyrrolidine - Heteroaromatic compound - Tertiary carboxylic acid amide - Thiazole - Vinylogous acid - Cyclic ketone - Carboxamide group - Ketone - Lactam - Azacycle - Oxacycle - Carboxylic acid derivative - Enol - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Organic oxygen compound - Organic nitrogen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzothiazoles. These are organic compounds containing a benzene fused to a thiazole ring (a five-membered ring with four carbon atoms, one nitrogen atom and one sulfur atom).
External Descriptors
Not available